4-imidazol-1-yl-3-nitro-N-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]benzamide

Systemtic Name: 4-imidazol-1-yl-3-nitro-N-[3-(2-oxidanylidenepyrrolidin-1-yl)phenyl]benzamide Openeye Name: 4-imidazol-1-yl-3-nitro-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide CAS Name: 4-(1-imidazolyl)-3-nitro-N-[3-(2-oxo-1-pyrrolidinyl)phenyl]benzamide IUPAC Name: 4-imidazol-1-yl-3-nitro-N-[3-(2-oxopyrrolidin-1-yl)phenyl]benzamide Traditional Name: 4-imidazol-1-yl-N-[3-(2-ketopyrrolidino)phenyl]-3-nitro-benzamide Formula: C20H17N5O4 MolecularWeight: 391.38008

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC(=CC=C2)NC(=O)C3=CC(=C(C=C3)N4C=CN=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC(=O)N(C1)C2=CC(=CC=C2)NC(=O)C3=CC(=C(C=C3)N4C=CN=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H17N5O4/c26-19-5-2-9-24(19)16-4-1-3-15(12-16)22-20(27)14-6-7-17(18(11-14)25(28)29)23-10-8-21-13-23/h1,3-4,6-8,10-13H,2,5,9H2,(H,22,27)